As the global demand for clean energy continues to rise, hydrogen, as a promising clean
energy carrier, is increasingly becoming the focus of international attention. This paper aims …

Batteries and hydrogen energy devices are considered the most critical technologies for
achieving zero carbon dioxide emissions. However, they still suffer from several limitations …

The structural, electronic, elastic, optical, phonon, and thermo-physical properties of the
tetragonal X 2 CoH 5 (X= Ca, Sr) hydrogen storage compounds were thoroughly examined …

Hydrogen energy plays a growing role in the present energy market and attracts more
attention in scientific researches and commercial application. Hydrogen energy has an …

This study investigates strain engineering to optimize hydrogen storage in Mg₂NiH₄, with
a focus on enhancing ionic conductivity and approaching room-temperature desorption …

Abstract Calcium aluminates (CaAl 2 O 4) have garnered significant attention due to their
unique properties in various applications. In this research, the first-principles of Density …

Mg has been proposed as a possible hydrogen storage material. However, Mg necessarily
requires the addition of a suitable material with catalytic activity to improve hydriding and …

To identify effective hydrogen storage materials, a novel study employing first-principles
calculations based on density functional theory DFT on the lithium-based double perovskite …

Hydrogen energy is highly potential in carrying a big weight in future energy market due to
its wonderful environmental friendliness and applicable flexibility. In order to search …

The structural, electronic, mechanical, optical, vibrational, and thermal properties of
tetragonal Rb 2 SnH 4 belonging to the space group P4 2/mnm as a hydrogen storage …